# generated using pymatgen
data_Li11Ti12(NiO8)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.42517680
_cell_length_b   8.42517680
_cell_length_c   8.42517637
_cell_angle_alpha   90.09737053
_cell_angle_beta   90.09737053
_cell_angle_gamma   90.09737639
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li11Ti12(NiO8)4
_chemical_formula_sum   'Li11 Ti12 Ni4 O32'
_cell_volume   598.04679104
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Li  Li0  1  0.12660800  0.12660800  0.12660800  1
  Li  Li1  1  0.50000000  0.24801800  0.75198200  1
  Li  Li2  1  0.75155100  0.24844900  0.50000000  1
  Li  Li3  1  0.49795700  0.50204300  0.00000000  1
  Li  Li4  1  0.75198200  0.50000000  0.24801800  1
  Li  Li5  1  0.24844900  0.50000000  0.75155100  1
  Li  Li6  1  0.00000000  0.49795700  0.50204300  1
  Li  Li7  1  0.50000000  0.75155100  0.24844900  1
  Li  Li8  1  0.24801800  0.75198200  0.50000000  1
  Li  Li9  1  0.87339200  0.87339200  0.87339200  1
  Li  Li10  1  0.50204300  0.00000000  0.49795700  1
  Ti  Ti11  1  0.75931600  0.24068400  0.00000000  1
  Ti  Ti12  1  0.49716200  0.24266600  0.24529900  1
  Ti  Ti13  1  0.24266600  0.24529900  0.49716200  1
  Ti  Ti14  1  0.75733400  0.50283800  0.75470100  1
  Ti  Ti15  1  0.00201800  0.50000000  0.99798200  1
  Ti  Ti16  1  0.24529900  0.49716200  0.24266600  1
  Ti  Ti17  1  0.50283800  0.75470100  0.75733400  1
  Ti  Ti18  1  0.75470100  0.75733400  0.50283800  1
  Ti  Ti19  1  0.00000000  0.75931600  0.24068400  1
  Ti  Ti20  1  0.50000000  0.99798200  0.00201800  1
  Ti  Ti21  1  0.24068400  0.00000000  0.75931600  1
  Ti  Ti22  1  0.99798200  0.00201800  0.50000000  1
  Ni  Ni23  1  0.00000000  0.24549000  0.75451000  1
  Ni  Ni24  1  0.50000000  0.50000000  0.50000000  1
  Ni  Ni25  1  0.24549000  0.75451000  0.00000000  1
  Ni  Ni26  1  0.75451000  0.00000000  0.24549000  1
  O  O27  1  0.72963300  0.25194100  0.23648600  1
  O  O28  1  0.51533800  0.24080900  0.00807300  1
  O  O29  1  0.25194100  0.23648600  0.72963300  1
  O  O30  1  0.00767500  0.23905300  0.51052300  1
  O  O31  1  0.74805900  0.27036700  0.76351400  1
  O  O32  1  0.98465400  0.26373700  0.99895400  1
  O  O33  1  0.26087500  0.26087500  0.26087500  1
  O  O34  1  0.48846700  0.24982800  0.48377400  1
  O  O35  1  0.99232500  0.48947700  0.76094700  1
  O  O36  1  0.75919100  0.48466200  0.99192700  1
  O  O37  1  0.48377400  0.48846700  0.24982800  1
  O  O38  1  0.24982800  0.48377400  0.48846700  1
  O  O39  1  0.51153300  0.51622600  0.75017200  1
  O  O40  1  0.75017200  0.51153300  0.51622600  1
  O  O41  1  0.00807300  0.51533800  0.24080900  1
  O  O42  1  0.23905300  0.51052300  0.00767500  1
  O  O43  1  0.51622600  0.75017200  0.51153300  1
  O  O44  1  0.73912500  0.73912500  0.73912500  1
  O  O45  1  0.00104600  0.73626300  0.01534600  1
  O  O46  1  0.23648600  0.72963300  0.25194100  1
  O  O47  1  0.48947700  0.76094700  0.99232500  1
  O  O48  1  0.27036700  0.76351400  0.74805900  1
  O  O49  1  0.99192700  0.75919100  0.48466200  1
  O  O50  1  0.76351400  0.74805900  0.27036700  1
  O  O51  1  0.26373700  0.99895400  0.98465400  1
  O  O52  1  0.48466200  0.99192700  0.75919100  1
  O  O53  1  0.76094700  0.99232500  0.48947700  1
  O  O54  1  0.99895400  0.98465400  0.26373700  1
  O  O55  1  0.73626300  0.01534600  0.00104600  1
  O  O56  1  0.51052300  0.00767500  0.23905300  1
  O  O57  1  0.24080900  0.00807300  0.51533800  1
  O  O58  1  0.01534600  0.00104600  0.73626300  1
